2-(3-hydroxyphenyl)acetate

C8H7O3- — CID 6950813

IUPAC2-(3-hydroxyphenyl)acetate
SMILESO=C([O-])Cc1cccc(O)c1
InChIInChI=1S/C8H8O3/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)/p-1
InChIKeyFVMDYYGIDFPZAX-UHFFFAOYSA-M
MW151.14 g/mol
LogP-0.32
Rot. Bonds2

About 2-(3-hydroxyphenyl)acetate

2-(3-hydroxyphenyl)acetate (PubChem CID 6950813) has the molecular formula C8H7O3- and a molecular weight of 151.14 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)acetate.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)acetate
PubChem CID6950813
Molecular FormulaC8H7O3-
Molecular Weight151.14 g/mol
Exact Mass151.04
IUPAC Name2-(3-hydroxyphenyl)acetate
SMILESO=C([O-])Cc1cccc(O)c1
InChIInChI=1S/C8H8O3/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)/p-1
InChIKeyFVMDYYGIDFPZAX-UHFFFAOYSA-M
XLogP-0.32
TPSA60.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)acetate?
The IUPAC name of 2-(3-hydroxyphenyl)acetate (CID 6950813) is 2-(3-hydroxyphenyl)acetate.
What is the SMILES notation for 2-(3-hydroxyphenyl)acetate?
The canonical SMILES for 2-(3-hydroxyphenyl)acetate is O=C([O-])Cc1cccc(O)c1.
What is the InChIKey of 2-(3-hydroxyphenyl)acetate?
The InChIKey is FVMDYYGIDFPZAX-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H8O3/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)/p-1.
What are the key properties of 2-(3-hydroxyphenyl)acetate?
2-(3-hydroxyphenyl)acetate has a molecular weight of 151.14 g/mol, XLogP of -0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)acetate is sourced from PubChem (CID 6950813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).